triethyl-[1-[(Z)-1-[(4-nitrophenyl)methoxy]-1-oxidanyl-3-oxidanylidene-5-phenylsulfanyl-pent-1-en-2-yl]-4-oxidanylidene-azetidin-2-yl]azanium

Systemtic Name: triethyl-[1-[(Z)-1-[(4-nitrophenyl)methoxy]-1-oxidanyl-3-oxidanylidene-5-phenylsulfanyl-pent-1-en-2-yl]-4-oxidanylidene-azetidin-2-yl]azanium Openeye Name: triethyl-[1-[(1Z)-1-[hydroxy-[(4-nitrophenyl)methoxy]methylene]-2-oxo-4-phenylsulfanyl-butyl]-4-oxo-azetidin-2-yl]ammonium CAS Name: triethyl-[1-[(Z)-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxo-5-(phenylthio)pent-1-en-2-yl]-4-oxo-2-azetidinyl]ammonium IUPAC Name: triethyl-[1-[(Z)-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxo-5-phenylsulfanylpent-1-en-2-yl]-4-oxoazetidin-2-yl]azanium Traditional Name: triethyl-[1-[(Z)-2-hydroxy-2-(4-nitrobenzyl)oxy-1-[3-(phenylthio)propanoyl]vinyl]-4-keto-azetidin-2-yl]ammonium Formula: C27H34N3O6S+ MolecularWeight: 528.64036

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)C1CC(=O)N1C(=C(O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCSC3=CC=CC=C3

Isomeric SMILES

CC[N+](CC)(CC)C1CC(=O)N1/C(=C(/O)\OCC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C27H33N3O6S/c1-4-30(5-2,6-3)24-18-25(32)28(24)26(23(31)16-17-37-22-10-8-7-9-11-22)27(33)36-19-20-12-14-21(15-13-20)29(34)35/h7-15,24H,4-6,16-19H2,1-3H3/p+1